Spectrum Details
BMDB ID:BMDB0000939
Compound Name:S-Adenosylhomocysteine
Derivative IUPAC Name:Not Available
Derivative SMILES:C[Si](C)(C)O[C@@H]1[C@@H](CSCC[C@H](N)C(=O)O)O[C@@H](N2C=NC3=C(N)N=CN=C32)[C@@H]1O
Derivative InChIKey:Not Available
Spectrum Type:Predicted GC-MS Spectrum - GC-MS (TMS_1_2) - 70eV, Positive
Splash Key:Not Available
Notes:This is a predicted spectrum, and it should only be used as a guide. Further evidence is required to confirm identification.
Spectrum View
Experimental Conditions
Ionization Mode:Positive
Ionization Energy:70 eV
Chromatography Type:Gas Chromatography Column (GC)
Instrument Type:Single quadrupole, spectrum predicted by CFM-ID(EI)
Mass Resolution:0.0001 Da
Molecular Formula:C14H20N6O5S
Molecular Weight (Monoisotopic Mass):384.1216 Da
Derivative Type:TMS_1_2
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)O[C@@H]1[C@@H](CSCC[C@H](N)C(=O)O)O[C@@H](N2C=NC3=C(N)N=CN=C32)[C@@H]1O)
Documentation
Document DescriptionDownloadFile Size
List of m/z values for the spectrum (TXT)Download file755 Bytes
mzML formatted file (MZML)Download file4.66 KB
References
Not Available